N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide
Compound characteristics
| Compound ID: | F379-1695 |
| Compound Name: | N-(3-acetylphenyl)-4-(azepane-1-sulfonyl)-3,5-dimethyl-1H-pyrrole-2-carboxamide |
| Molecular Weight: | 417.53 |
| Molecular Formula: | C21 H27 N3 O4 S |
| Smiles: | CC(c1cccc(c1)NC(c1c(C)c(c(C)[nH]1)S(N1CCCCCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.0213 |
| logD: | 3.0129 |
| logSw: | -3.4107 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.18 |
| InChI Key: | XNXAAJKVQBGKDP-UHFFFAOYSA-N |